ethyl 3-[4-[4-[1-(phenylcarbonyl)piperidin-4-yl]butoxy]phenyl]propanoate

Systemtic Name: ethyl 3-[4-[4-[1-(phenylcarbonyl)piperidin-4-yl]butoxy]phenyl]propanoate Openeye Name: ethyl 3-[4-[4-(1-benzoyl-4-piperidyl)butoxy]phenyl]propanoate CAS Name: 3-[4-[4-(1-benzoyl-4-piperidinyl)butoxy]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-[4-(1-benzoylpiperidin-4-yl)butoxy]phenyl]propanoate Traditional Name: 3-[4-[4-(1-benzoyl-4-piperidyl)butoxy]phenyl]propionic acid ethyl ester Formula: C27H35NO4 MolecularWeight: 437.5711

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC=C(C=C1)OCCCCC2CCN(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CCC1=CC=C(C=C1)OCCCCC2CCN(CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H35NO4/c1-2-31-26(29)16-13-23-11-14-25(15-12-23)32-21-7-6-8-22-17-19-28(20-18-22)27(30)24-9-4-3-5-10-24/h3-5,9-12,14-15,22H,2,6-8,13,16-21H2,1H3